4-azanyl-N-[(3-fluorophenyl)methyl]-1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]pyrrolidine-2-carboxamide

Systemtic Name: 4-azanyl-N-[(3-fluorophenyl)methyl]-1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]pyrrolidine-2-carboxamide Openeye Name: 4-amino-N-[(3-fluorophenyl)methyl]-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]pyrrolidine-2-carboxamide CAS Name: 4-amino-N-[(3-fluorophenyl)methyl]-1-[2-hydroxy-3-[[(3-hydroxy-2-methylphenyl)-oxomethyl]amino]-1-oxo-4-phenylbutyl]-2-pyrrolidinecarboxamide IUPAC Name: 4-amino-N-[(3-fluorophenyl)methyl]-1-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]pyrrolidine-2-carboxamide Traditional Name: 4-amino-N-(3-fluorobenzyl)-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]pyrrolidine-2-carboxamide Formula: C30H33FN4O5 MolecularWeight: 548.605223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CC(CC3C(=O)NCC4=CC(=CC=C4)F)N)O

Isomeric SMILES

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CC(CC3C(=O)NCC4=CC(=CC=C4)F)N)O

InChI

InChI=1S/C30H33FN4O5/c1-18-23(11-6-12-26(18)36)28(38)34-24(14-19-7-3-2-4-8-19)27(37)30(40)35-17-22(32)15-25(35)29(39)33-16-20-9-5-10-21(31)13-20/h2-13,22,24-25,27,36-37H,14-17,32H2,1H3,(H,33,39)(H,34,38)